1NXM

The high resolution structures of RmlC from Streptococcus suis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-1
Synchrotron site	ESRF
Beamline	ID14-1
Temperature [K]	110
Detector technology	CCD
Collection date	2001-11-03
Detector	ADSC QUANTUM 4
Wavelength(s)	0.933
Spacegroup name	P 1 21 1
Unit cell lengths	45.671, 81.624, 52.098
Unit cell angles	90.00, 108.80, 90.00

Refinement procedure

Resolution	49.390 - 1.300
R-factor	0.14465
Rwork	0.143
R-free	0.17400 *
Structure solution method	SAD
RMSD bond length	0.013
RMSD bond angle	1.480 *
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MLPHARE
Refinement software	REFMAC (5.1.19)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.300	1.330
High resolution limit [Å]	1.300	1.300
Rmerge	0.039 *	0.241 *
Total number of observations	1012876 *
Number of reflections	85539 *
<I/σ(I)>	11.7	3.1
Completeness [%]	95.2	84 *
Redundancy	5.9	2.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	20 *	25% PEG 2000, 0.2 M MgCl2, 0.1 M Tris , 4 mM NiCl2, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	7 (mg/ml)
2	1	reservoir		0.2 (M)
3	1	reservoir	Tris-HCl	0.1 (M)	pH8.5
4	1	reservoir	PEG2000	25 (%)